2-[(4-bromophenyl)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[(4-bromophenyl)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[(4-bromophenyl)methylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[(4-bromophenyl)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[(4-bromophenyl)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[(4-bromobenzyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C16H15BrN2S MolecularWeight: 347.2727

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NCC3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NCC3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C16H15BrN2S/c17-12-7-5-11(6-8-12)10-19-16-14(9-18)13-3-1-2-4-15(13)20-16/h5-8,19H,1-4,10H2